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656834-98-9 | 1-Propene, 2-iodo-3-methoxy-
CAS No: 656834-98-9 Catalog No: AG006PRA MDL No:
Product Description
Catalog Number:
AG006PRA
Chemical Name:
1-Propene, 2-iodo-3-methoxy-
CAS Number:
656834-98-9
Molecular Formula:
C4H7IO
Molecular Weight:
198.0023
IUPAC Name:
2-iodo-3-methoxyprop-1-ene
InChI:
InChI=1S/C4H7IO/c1-4(5)3-6-2/h1,3H2,2H3
InChI Key:
YMPYRSORYITEAF-UHFFFAOYSA-N
SMILES:
COCC(=C)I
Properties
Complexity:
51.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.954g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.003g/mol
Monoisotopic Mass:
197.954g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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